Please wait a minute...
Frontiers of Physics

ISSN 2095-0462

ISSN 2095-0470(Online)

CN 11-5994/O4

邮发代号 80-965

2019 Impact Factor: 2.502

Frontiers of Physics  2019, Vol. 14 Issue (3): 33403   https://doi.org/10.1007/s11467-019-0884-5
  本期目录
Review of borophene and its potential applications
Zhi-Qiang Wang1,2, Tie-Yu Lü1, Hui-Qiong Wang1,3, Yuan Ping Feng2(), Jin-Cheng Zheng1,3,4()
1. Department of Physics, and Collaborative Innovation Center for Optoelectronic Semiconductors and Efficient Devices, Xiamen University, Xiamen 361005, China
2. Department of Physics, National University of Singapore, Singapore 117542, Singapore
3. Institute of Artificial Intelligence, Xiamen University Malaysia, 439000 Sepang, Selangor, Malaysia
4. Fujian Provincial Key Laboratory of Theoretical and Computational Chemistry, Xiamen University, Xiamen 361005, China
 全文: PDF(4243 KB)  
Abstract

Since two-dimensional boron sheet (borophene) synthesized on Ag substrates in 2015, research on borophene has grown fast in the fields of condensed matter physics, chemistry, material science, and nanotechnology. Due to the unique physical and chemical properties, borophene has various potential applications. In this review, we summarize the progress on borophene with a particular emphasis on the recent advances. First, we introduce the phases of borophene by experimental synthesis and theoretical predictions. Then, the physical and chemical properties, such as mechanical, thermal, electronic, optical and superconducting properties are summarized. We also discuss in detail the utilization of the borophene for wide ranges of potential application among the alkali metal ion batteries, Li-S batteries, hydrogen storage, supercapacitor, sensor and catalytic in hydrogen evolution, oxygen reduction, oxygen evolution, and CO2 electroreduction reaction. Finally, the challenges and outlooks in this promising field are featured on the basis of its current development.

Key wordsborophene    structural diversity    high anisotropy    boron vacancy concentration
收稿日期: 2018-12-31      出版日期: 2019-04-11
Corresponding Author(s): Yuan Ping Feng,Jin-Cheng Zheng   
 引用本文:   
. [J]. Frontiers of Physics, 2019, 14(3): 33403.
Zhi-Qiang Wang, Tie-Yu Lü, Hui-Qiong Wang, Yuan Ping Feng, Jin-Cheng Zheng. Review of borophene and its potential applications. Front. Phys. , 2019, 14(3): 33403.
 链接本文:  
https://academic.hep.com.cn/fop/CN/10.1007/s11467-019-0884-5
https://academic.hep.com.cn/fop/CN/Y2019/V14/I3/33403
1 K. S. Novoselov, A. K. Geim, S. V. Morozov, D. Jiang, M. I. Katsnelson, I. V. Grigorieva, S. V. Dubonos, and A. A. Firsov, Two-dimensional gas of massless Dirac fermions in graphene, Nature 438(7065), 197 (2005)
https://doi.org/10.1038/nature04233
2 Y. Zhang, Y. W. Tan, H. L. Stormer, and P. Kim, Experimental observation of the quantum Hall effect and Berry’s phase in graphene, Nature 438(7065), 201 (2005)
https://doi.org/10.1038/nature04235
3 A. C. Ferrari, J. C. Meyer, V. Scardaci, C. Casiraghi, M. Lazzeri, F. Mauri, S. Piscanec, D. Jiang, K. S. Novoselov, S. Roth, and A. K. Geim, Raman spectrum of grapheme and graphene layers, Phys. Rev. Lett. 97(18), 187401 (2006)
https://doi.org/10.1103/PhysRevLett.97.187401
4 H. J. Yan, B. Xu, S. Q. Shi, and C. Y. Ouyang, Firstprinciples study of the oxygen adsorption and dissociation on graphene and nitrogen doped graphene for Li-air batteries, J. Appl. Phys. 112(10), 104316 (2012)
https://doi.org/10.1063/1.4766919
5 N. Wei, Y. Chen, K. Cai, J. Zhao, H. Q. Wang, and J. C. Zheng, Thermal conductivity of graphene kirigami: Ultralow and strain robustness, Carbon 104, 203 (2016)
https://doi.org/10.1016/j.carbon.2016.03.043
6 Y. Chen, Y. Zhang, K. Cai, J. Jiang, J. C. Zheng, J. Zhao, and N. Wei, Interfacial thermal conductance in graphene/black phosphorus heterogeneous structures, Carbon 117, 399 (2017)
https://doi.org/10.1016/j.carbon.2017.03.011
7 Y. H. Lu, W. Chen, Y. P. Feng, and P. M. He, Tuning the electronic structure of graphene by an organic molecule, J. Phys. Chem. B 113(1), 2 (2009)
https://doi.org/10.1021/jp806905e
8 Y. P. Feng, L. Shen, M. Yang, A. Z. Wang, M. G. Zeng, Q. Y. Wu, S. Chintalapati, and C. R. Chang, Prospects of spintronics based on 2D materials, WIRES Comput. Mol. Sci. 7(5), e1313 (2017)
https://doi.org/10.1002/wcms.1313
9 N. Wei, L. Xu, H. Q. Wang, and J. C. Zheng, Strain engineering of thermal conductivity in graphene sheets and nanoribbons: a demonstration of magic flexibility, Nanotechnology 22(10), 105705 (2011)
https://doi.org/10.1088/0957-4484/22/10/105705
10 L. Q. Xu, N. Wei, Y. P. Zheng, Z. Y. Fan, H. Q. Wang, and J. C. Zheng, Graphene-nanotube 3D networks: Intriguing thermal and mechanical properties, J. Mater. Chem. 22(4), 1435 (2012)
https://doi.org/10.1039/C1JM13799A
11 F. Rao, Z. Wang, B. Xu, L. Chen, and C. Ouyang, Firstprinciples study of lithium and sodium atoms intercalation in fluorinated graphite, Engineering 1(2), 243 (2015)
https://doi.org/10.15302/J-ENG-2015039
12 K. Watanabe, T. Taniguchi, and H. Kanda, Directbandgap properties and evidence for ultraviolet lasing of hexagonal boron nitride single crystal, Nat. Mater. 3(6), 404 (2004)
https://doi.org/10.1038/nmat1134
13 G. Liu, X. L. Lei, M. S. Wu, B. Xu, and C. Y. Ouyang, Comparison of the stability of free-standing silicene and hydrogenated silicene in oxygen: A first principles investigation, J. Phys.: Condens. Matter 26(35), 355007 (2014)
https://doi.org/10.1088/0953-8984/26/35/355007
14 A. Molle, C. Grazianetti, L. Tao, D. Taneja, M. H. Alam, and D. Akinwande, Silicene, silicene derivatives, and their device applications, Chem. Soc. Rev. 47(16), 6370 (2018)
https://doi.org/10.1039/C8CS00338F
15 G. Li, L. Zhang, W. Xu, J. Pan, S. Song, Y. Zhang, H. Zhou, Y. Wang, L. Bao, Y. Y. Zhang, S. Du, M. Ouyang, S. T. Pantelides, and H. J. Gao, Stable silicone in graphene/silicene van der Waals heterostructures, Adv. Mater. 30(49), 1804650 (2018)
https://doi.org/10.1002/adma.201804650
16 G. Liu, S. B. Liu, B. Xu, C. Y. Ouyang, H. Y. Song, S. Guan, and S. A. Yang, Multiple Dirac points and hydrogenation-induced magnetism of germanene layer on Al(111) surface, J. Phys. Chem. Lett. 6(24), 4936 (2015)
https://doi.org/10.1021/acs.jpclett.5b02413
17 X. R. Hu, J. M. Zheng, and Z. Y. Ren, Strong interlayer coupling in phosphorene/graphene van der Waals heterostructure: A first-principles investigation, Front. Phys.13, 137302 (2017)
https://doi.org/10.1007/s11467-017-0736-0
18 Y. Q. Cai, Z. Q. Bai, H. Pan, Y. P. Feng, B. I. Yakobson, and Y. W. Zhang, Constructing metallic nanoroads on a MoS(2) monolayer via hydrogenation, Nanoscale 6(3), 1691 (2014)
https://doi.org/10.1039/C3NR05218D
19 Q. H. Wang, K. Kalantar-Zadeh, A. Kis, J. N. Coleman, and M. S. Strano, Electronics and optoelectronics of twodimensional transition metal dichalcogenides, Nat. Nanotechnol. 7(11), 699 (2012)
https://doi.org/10.1038/nnano.2012.193
20 J. Pei, J. Yang, R. Xu, Y. H. Zeng, Y. W. Myint, S. Zhang, J. C. Zheng, Q. Qin, X. Wang, W. Jiang, and Y. Lu, Exciton and trion dynamics in bilayer MoS2, Small 11(48), 6384 (2015)
https://doi.org/10.1002/smll.201501949
21 J. Pei, J. Yang, X. Wang, F. Wang, S. Mokkapati, T. Lu, J. C. Zheng, Q. Qin, D. Neshev, H. H. Tan, C. Jagadish, and Y. Lu, Excited state biexcitons in atomically thin MoSe2, ACS Nano 11(7), 7468 (2017)
https://doi.org/10.1021/acsnano.7b03909
22 C. Shang, B. Xu, X. Lei, S. Yu, D. Chen, M. Wu, B. Sun, G. Liu, and C. Ouyang, Bandgap tuning in MoSSe bilayers: Synergistic effects of dipole moment and interlayer distance, Phys. Chem. Chem. Phys. 20(32), 20919 (2018)
https://doi.org/10.1039/C8CP04208J
23 J. Mao, Y. Wang, Z. Zheng, and D. Deng, The rise of two-dimensional MoS2 for catalysis, Front. Phys. 13(4), 138118 (2018)
https://doi.org/10.1007/s11467-018-0812-0
24 S. Zhang, Z. Yan, Y. Li, Z. Chen, and H. Zeng, Atomically thin arsenene and antimonene: Semimetal-semiconductor and indirect-direct band-gap transitions, Angew. Chem. Int. Ed. 54(10), 3112 (2015)
https://doi.org/10.1002/anie.201411246
25 J. Ji, X. Song, J. Liu, Z. Yan, C. Huo, S. Zhang, M. Su, L. Liao, W. Wang, Z. Ni, Y. Hao, and H. Zeng, Twodimensional antimonene single crystals grown by van der Waals epitaxy, Nat. Commun. 7(1), 13352 (2016)
https://doi.org/10.1038/ncomms13352
26 A. J. Mannix, X. F. Zhou, B. Kiraly, J. D. Wood, D. Alducin, B. D. Myers, X. Liu, B. L. Fisher, U. Santiago, J. R. Guest, M. J. Yacaman, A. Ponce, A. R. Oganov, M. C. Hersam, and N. P. Guisinger, Synthesis of borophenes: Anisotropic, two-dimensional boron polymorphs, Science 350(6267), 1513 (2015)
https://doi.org/10.1126/science.aad1080
27 W. Li, L. Kong, C. Chen, J. Gou, S. Sheng, W. Zhang, H. Li, L. Chen, P. Cheng, and K. Wu, Experimental realization of honeycomb borophene, Sci. Bull. (Beijing) 63(5), 282 (2018)
https://doi.org/10.1016/j.scib.2018.02.006
28 B. Feng, J. Zhang, Q. Zhong, W. Li, S. Li, H. Li, P. Cheng, S. Meng, L. Chen, and K. Wu, Experimental realization of two-dimensional boron sheets, Nat. Chem. 8(6), 563 (2016)
https://doi.org/10.1038/nchem.2491
29 E. S. Penev, A. Kutana, and B. I. Yakobson, Can twodimensional boron superconduct? Nano Lett. 16(4), 2522 (2016)
https://doi.org/10.1021/acs.nanolett.6b00070
30 S. G. Xu, Y. J. Zhao, J. H. Liao, X. B. Yang, and H. Xu, The nucleation and growth of borophene on the Ag(111) surface, Nano Res. 9(9), 2616 (2016)
https://doi.org/10.1007/s12274-016-1148-0
31 A. Lopez-Bezanilla and P.B. Littlewood, Electronic properties of 8–Pmmn borophene, Phys. Rev. B 93, 241405(R) (2016)
32 B. Peng, H. Zhang, H. Z. Shao, Y. F. Xu, R. J. Zhang, and H. Y. Zhu, Electronic, optical, and thermodynamic properties of borophene from first-principle calculations, J. Mater. Chem. C 4(16), 3592 (2016)
https://doi.org/10.1039/C6TC00115G
33 J. Carrete, W. Li, L. Lindsay, D. A. Broido, L. J. Gallego, and N. Mingo, Physically founded phonon dispersions of few-layer materials and the case of borophene, Mater. Res. Lett. 4(4), 204 (2016)
https://doi.org/10.1080/21663831.2016.1174163
34 H. F. Wang, Q. F. Li, Y. Gao, F. Miao, X. F. Zhou, and X. G. Wan, Strain effects on borophene: Ideal strength, negative Possion’s ratio and phonon instability, New J. Phys. 18(7), 073016 (2016)
https://doi.org/10.1088/1367-2630/18/7/073016
35 R. C. Xiao, D. F. Shao, W. J. Lu, H. Y. Lv, J. Y. Li, and Y. P. Sun, Enhanced superconductivity by strain and carrier-doping in borophene: A first principles prediction, Appl. Phys. Lett. 109(12), 122604 (2016)
https://doi.org/10.1063/1.4963179
36 M. Gao, Q. Z. Li, X. W. Yan, and J. Wang, Prediction of phonon-mediated superconductivity in borophene, Phys. Rev. B 95(2), 024505 (2017)
https://doi.org/10.1103/PhysRevB.95.024505
37 Y. X. Liu, Y. J. Dong, Z. Y. Tang, X. F. Wang, L. Wang, T. J. Hou, H. P. Lin, and Y. Y. Li, Stable and metallic borophene nanoribbons from first-principles calculations, J. Mater. Chem. C 4(26), 6380 (2016)
https://doi.org/10.1039/C6TC01328G
38 X. B. Yang, Y. Ding, and J. Ni, Ab initio prediction of stable boron sheets and boron nanotubes: Structure, stability, and electronic properties, Phys. Rev. B 77, 041402(R) (2008)
39 A. D. Zabolotskiy and Y. E. Lozovik, Strain-induced pseudomagnetic field in Dirac semimetal borophene, Phys. Rev. B 94(16), 165403 (2016)
https://doi.org/10.1103/PhysRevB.94.165403
40 J. H. Yuan, L. W. Zhang, and K. M. Liew, Effect of grafted amine groups on in-plane tensile properties and high temperature structural stability of borophene nanoribbons, RSC Advances 5(91), 74399 (2015)
https://doi.org/10.1039/C5RA14939H
41 H. Liu, J. Gao, and J. Zhao, From boron cluster to twodimensional boron sheet on Cu(111) surface: Growth mechanism and hole formation, Sci. Rep. 3(1), 3238 (2013)
https://doi.org/10.1038/srep03238
42 X. M. Zhang, J. P. Hu, Y. C. Cheng, H. Y. Yang, Y. G. Yao, and S. Y. Yang, Borophene as an extremely high capacity electrode material for Li-ion and Na-ion batteries, Nanoscale 8(33), 15340 (2016)
https://doi.org/10.1039/C6NR04186H
43 H. Shu, F. Li, P. Liang, and X. Chen, Unveiling the atomic structure and electronic properties of atomically thin boron sheets on an Ag(111) surface, Nanoscale 8(36), 16284 (2016)
https://doi.org/10.1039/C6NR02871C
44 X. Liu, Z. Zhang, L. Wang, B. I. Yakobson, and M. C. Hersam, Intermixing and periodic self-assembly of borophene line defects, Nat. Mater. 17(9), 783 (2018)
https://doi.org/10.1038/s41563-018-0134-1
45 V. Wang and W. T. Geng, Lattice defects and the mechanical anisotropy of borophene, J. Phys. Chem. C 121(18), 10224 (2017)
https://doi.org/10.1021/acs.jpcc.7b02582
46 Z. Pang, X. Qian, Y. Wei, and R. Yang, Super-stretchable borophene, EPL 116(3), 36001 (2016)
https://doi.org/10.1209/0295-5075/116/36001
47 Y. An, J. Jiao, Y. Hou, H. Wang, R. Wu, C. Liu, X. Chen, T. Wang, and K. Wang, Negative differential conductance effect and electrical anisotropy of 2D ZrB2 monolayers, J. Phys.: Condens. Matter 31, 065301 (2019)
https://doi.org/10.1088/1361-648X/aaf5b2
48 X. Tang, W. Sun, C. Lu, L. Kou, and C. Chen, Atomically thin NiB6 monolayer: A robust Dirac material, Phys. Chem. Chem. Phys. 21, 617 (2019)
https://doi.org/10.1039/C8CP05778H
49 H. Cui, X. Zhang, and D. Chen, Borophene: A promising adsorbent material with strong ability and capacity for SO2 adsorption, Appl. Phys. A 124, 636 (2018)
https://doi.org/10.1007/s00339-018-2064-9
50 L. Kong, K. Wu, and L. Chen, Recent progress on borophene: Growth and structures, Front. Phys. 13(3), 138105 (2018)
https://doi.org/10.1007/s11467-018-0752-8
51 A. Lherbier, A. R. Botello-Méndez, and J.C. Charlier, Electronic and optical properties of pristine and oxidized borophene, 2D Materials 3, 045006 (2016)
52 E. S. Penev, S. Bhowmick, A. Sadrzadeh, and B. I. Yakobson, Polymorphism of two-dimensional boron, Nano Lett. 12(5), 2441 (2012)
https://doi.org/10.1021/nl3004754
53 Z. H. Zhang, Y. Yang, E. S. Penev, and B. I. Yakobson, Elasticity, flexibility, and ideal strength of borophenes, Adv. Funct. Mater. 27(9), 1605059 (2017)
https://doi.org/10.1002/adfm.201605059
54 Y. Zhao, S. Zeng, and J. Ni, Superconductivity in twodimensional boron allotropes, Phys. Rev. B 93, 014502 (2016)
https://doi.org/10.1103/PhysRevB.93.014502
55 X. Yang, Y. Ding, and J. Ni, Ab initio prediction of stable boron sheets and boron nanotubes: structure, stability, and electronic properties, Phys. Rev. B 77, 041402 (2008)
https://doi.org/10.1103/PhysRevB.77.041402
56 Z. Zhang, E. S. Penev, and B. I. Yakobson, Twodimensional materials: Polyphony in B flat, Nat. Chem. 8(6), 525 (2016)
https://doi.org/10.1038/nchem.2521
57 T. Tsafack and B. I. Yakobson, Thermomechanical analysis of two-dimensional boron monolayers, Phys. Rev. B 93, 165434 (2016)
https://doi.org/10.1103/PhysRevB.93.165434
58 Z. Zhang, A. J. Mannix, Z. Hu, B. Kiraly, N. P. Guisinger, M. C. Hersam, and B. I. Yakobson, Substrate-induced nanoscale undulations of borophene on silver, Nano Lett. 16(10), 6622 (2016)
https://doi.org/10.1021/acs.nanolett.6b03349
59 Y. Liu, E. S. Penev, and B. I. Yakobson, Probing the synthesis of two-dimensional boron by first-principles computations, Angew. Chem. Int. Ed. 52(11), 3156 (2013)
https://doi.org/10.1002/anie.201207972
60 F. Ma, Y. Jiao, G. Gao, Y. Gu, A. Bilic, Z. Chen, and A. Du, Graphene-like two-dimensional ionic boron with double Dirac cones at ambient condition, Nano Lett. 16(5), 3022 (2016)
https://doi.org/10.1021/acs.nanolett.5b05292
61 Y. Zhao, S. Zeng, and J. Ni, Phonon-mediated superconductivity in borophenes, Appl. Phys. Lett. 108(24), 242601 (2016)
https://doi.org/10.1063/1.4953775
62 Z. H. Zhang, Y. Yang, G. Y. Gao, and B. I. Yakobson, Two-dimensional boron monolayers mediated by metal substrates, Angew. Chem. Int. Ed. 54(44), 13022 (2015)
https://doi.org/10.1002/anie.201505425
63 R. Balog, B. Jorgensen, L. Nilsson, M. Andersen, E. Rienks, M. Bianchi, M. Fanetti, E. Laegsgaard, A. Baraldi, S. Lizzit, Z. Sljivancanin, F. Besenbacher, B. Hammer, T. G. Pedersen, P. Hofmann, and L. Hornekaer, Bandgap opening in graphene induced by patterned hydrogen adsorption, Nat. Mater. 9(4), 315 (2010)
https://doi.org/10.1038/nmat2710
64 A. Bhattacharya, S. Bhattacharya, and G. P. Das, Strain-induced band-gap deformation of H/F passivated graphene and h-BN sheet, Phys. Rev. B 84(7), 075454 (2011)
https://doi.org/10.1103/PhysRevB.84.075454
65 M. Houssa, E. Scalise, K. Sankaran, G. Pourtois, V. V. Afanas’ev, and A. Stesmans, Electronic properties of hydrogenated silicene and germanene, Appl. Phys. Lett. 98(22), 223107 (2011)
https://doi.org/10.1063/1.3595682
66 Y. Jiao, F. Ma, J. Bell, A. Bilic, and A. Du, Twodimensional boron hydride sheets: high stability, massless Dirac fermions, and excellent mechanical properties, Angew. Chem. Int. Ed. 55(35), 10292 (2016)
https://doi.org/10.1002/anie.201604369
67 L. C. Xu, A. Du, and L. Kou, Hydrogenated borophene as a stable two-dimensional Dirac material with an ultrahigh Fermi velocity, Phys. Chem. Chem. Phys. 18(39), 27284 (2016)
https://doi.org/10.1039/C6CP05405F
68 Z. Wang, T. Y. Lu, H. Q. Wang, Y. P. Feng, and J. C. Zheng, High anisotropy of fully hydrogenated borophene, Phys. Chem. Chem. Phys. 18(46), 31424 (2016)
https://doi.org/10.1039/C6CP06164H
69 G. I. Giannopoulos, Mechanical behavior of planar borophenes: A molecular mechanics study, Comput. Mater. Sci. 129, 304 (2017)
https://doi.org/10.1016/j.commatsci.2016.12.045
70 B. Mortazavi, O. Rahaman, A. Dianat, and T. Rabczuk, Mechanical responses of borophene sheets: A firstprinciples study, Phys. Chem. Chem. Phys. 18(39), 27405 (2016)
https://doi.org/10.1039/C6CP03828J
71 Q. Peng, L. Han, X. Wen, S. Liu, Z. Chen, J. Lian, and S. De, Mechanical properties and stabilities of alpha-boron monolayers, Phys. Chem. Chem. Phys. 17(3), 2160 (2015)
https://doi.org/10.1039/C4CP04050C
72 M. Q. Le, B. Mortazavi, and T. Rabczuk, Mechanical properties of borophene films: A reactive molecular dynamics investigation, Nanotechnology 27(44), 445709 (2016)
https://doi.org/10.1088/0957-4484/27/44/445709
73 L. Shao, Y. Li, Q. Yuan, M. Li, Y. Du, F. Zeng, P. Ding, and H. Ye, Effects of strain on mechanical and electronic properties of borophene, Mater. Res. Express 4(4), 045020 (2017)
https://doi.org/10.1088/2053-1591/aa6bba
74 R. Peköz, M. Konuk, M. E. Kilic, and E. Durgun, Twodimensional fluorinated boron sheets: Mechanical, electronic, and thermal properties, ACS Omega 3(2), 1815 (2018)
https://doi.org/10.1021/acsomega.7b01730
75 Q. Wei and X. Peng, Superior mechanical flexibility of phosphorene and few-layer black phosphorus, Appl. Phys. Lett. 104(25), 251915 (2014)
https://doi.org/10.1063/1.4885215
76 Y. P. Zhou and J. W. Jiang, Molecular dynamics simulations for mechanical properties of borophene: parameterization of valence force field model and Stillinger-Weber potential, Sci. Rep. 7(1), 45516 (2017)
https://doi.org/10.1038/srep45516
77 W. C. Yi, W. Liu, J. Botana, L. Zhao, Z. Liu, J. Y. Liu, and M. S. Miao, Honeycomb boron allotropes with Dirac cones: a true analogue to graphene, J. Phys. Chem. Lett. 8(12), 2647 (2017)
https://doi.org/10.1021/acs.jpclett.7b00891
78 H. Zhong, K. Huang, G. Yu, and S. Yuan, Electronic and mechanical properties of few-layer borophene, Phys. Rev. B 98(5), 054104 (2018)
https://doi.org/10.1103/PhysRevB.98.054104
79 Z. Q. Wang, H. Cheng, T. Y. Lu, H. Q. Wang, Y. P. Feng, and J. C. Zheng, A super-stretchable boron nanoribbon network, Phys. Chem. Chem. Phys. 20(24), 16510 (2018)
https://doi.org/10.1039/C8CP02257G
80 Z. Wang, T. Y. Lu, H. Q. Wang, Y. P. Feng, and J. C. Zheng, New crystal structure prediction of fully hydrogenated borophene by first principles calculations, Sci. Rep. 7(1), 609 (2017)
https://doi.org/10.1038/s41598-017-00667-x
81 R. C. Andrew, R. E. Mapasha, A. M. Ukpong, and N. Chetty, Mechanical properties of graphene and boronitrene, Phys. Rev. B 85(12), 125428 (2012)
https://doi.org/10.1103/PhysRevB.85.125428
82 X. D. Wei, B. Fragneaud, C. A. Marianetti, and J. W. Kysar, Nonlinear elastic behavior of graphene: Ab initiocalculations to continuum description, Phys. Rev. B 80(20), 205407 (2009)
https://doi.org/10.1103/PhysRevB.80.205407
83 J. Yuan, N. Yu, K. Xue, and X. Miao, Ideal strength and elastic instability in single-layer 8-Pmmn borophene, RSC Advances 7(14), 8654 (2017)
https://doi.org/10.1039/C6RA28454J
84 Q. Peng, C. Liang, W. Ji, and S. De, A first-principles study of the mechanical properties of g-GeC, Mech. Mater. 64, 135 (2013)
https://doi.org/10.1016/j.mechmat.2013.05.009
85 B. Mortazavi, O. Rahaman, M. Makaremi, A. Dianat, G. Cuniberti, and T. Rabczuk, First-principles investigation of mechanical properties of silicene, germanene and stanene, Physica E 87, 228 (2017)
https://doi.org/10.1016/j.physe.2016.10.047
86 D. F. Li, J. He, G. Q. Ding, Q. Q. Tang, Y. Ying, J. J. He, C. Y. Zhong, Y. Liu, C. B. Feng, Q. L. Sun, H. B. Zhou, P. Zhou, and G. Zhang, Stretch-driven increase in ultrahigh thermal conductance of hydrogenated borophene and dimensionality crossover in phonon transmission, Adv. Funct. Mater. 28(31), 1801685 (2018)
https://doi.org/10.1002/adfm.201801685
87 B. Mortazavi, M. Makaremi, M. Shahrokhi, M. Raeisi, C. V. Singh, T. Rabczuk, and L. F. C. Pereira, Borophene hydride: A stiff 2D material with high thermal conductivity and attractive optical and electronic properties, Nanoscale 10(8), 3759 (2018)
https://doi.org/10.1039/C7NR08725J
88 H. B. Zhou, Y. Q. Cai, G. Zhang, and Y. W. Zhang, Superior lattice thermal conductance of single-layer borophene, npj 2D Mater. Appl. 1, 14 (2017)
89 G. Liu, H. Wang, Y. Gao, J. Zhou, and H. Wang, Anisotropic intrinsic lattice thermal conductivity of borophane from first-principles calculations, Phys. Chem. Chem. Phys. 19(4), 2843 (2017)
https://doi.org/10.1039/C6CP07367K
90 H. Sun, Q. Li, and X. G. Wan, First-principles study of thermal properties of borophene, Phys. Chem. Chem. Phys. 18(22), 14927 (2016)
https://doi.org/10.1039/C6CP02029A
91 B. Mortazavi, M. Q. Le, T. Rabczuk, and L. F. C. Pereira, Anomalous strain effect on the thermal conductivity of borophene: A reactive molecular dynamics study, Physica E 93, 202 (2017)
https://doi.org/10.1016/j.physe.2017.06.012
92 H. Xiao, W. Cao, T. Ouyang, S. Guo, C. He, and J. Zhong, Lattice thermal conductivity of borophene from first principle calculation, Sci. Rep. 7(1), 45986 (2017)
https://doi.org/10.1038/srep45986
93 X. Gu and R. Yang, First-principles prediction of phononic thermal conductivity of silicene: A comparison with graphene, J. Appl. Phys. 117(2), 025102 (2015)
https://doi.org/10.1063/1.4905540
94 G. Qin, Q. B. Yan, Z. Qin, S. Y. Yue, M. Hu, and G. Su, Anisotropic intrinsic lattice thermal conductivity of phosphorene from first principles, Phys. Chem. Chem. Phys. 17(7), 4854 (2015)
https://doi.org/10.1039/C4CP04858J
95 H. J. Yan, Z. Q. Wang, B. Xu, and C. Y. Ouyang, Strain induced enhanced migration of polaron and lithium ion in l-MnO2, Funct. Mater. Lett. (Singap.) 5(04), 1250037 (2012)
https://doi.org/10.1142/S1793604712500373
96 Z. Q. Wang, M. S. Wu, G. Liu, X. L. Lei, X. Bo, and C. Y. Ouyang, Elastic properties of new solid state electrolyte material Li10GeP2S12: A study from first-principles calculations, Int. J. Electrochem. Sci. 9, 562 (2014)
97 T. Y. Lü, X. X. Liao, H. Q. Wang, and J. C. Zheng, Tuning the indirect–direct band gap transition of SiC, GeC and SnC monolayer in a graphene-like honeycomb structure by strain engineering: a quasiparticle GW study, J. Mater. Chem. 22(19), 10062 (2012)
https://doi.org/10.1039/c2jm30915g
98 V. Shukla, A. Grigoriev, N. K. Jena, and R. Ahuja, Strain controlled electronic and transport anisotropies in twodimensional borophene sheets, Phys. Chem. Chem. Phys. 20(35), 22952 (2018)
https://doi.org/10.1039/C8CP03815E
99 Z. Q. Wang, T. Y. Lü, H. Q. Wang, Y. P. Feng, and J. C. Zheng, Band structure engineering of borophane by first principles calculations, RSC Advances 7(75), 47746 (2017)
https://doi.org/10.1039/C7RA05704K
100 B. Peng, H. Zhang, H. Shao, Y. Xu, R. Zhang, and H. Zhu, The electronic, optical, and thermodynamic properties of borophene from first-principles calculations, J. Mater. Chem. C 4, 3592 (2016)
https://doi.org/10.1039/C6TC00115G
101 J. H. Liao, Y. C. Zhao, Y. J. Zhao, H. Xu, and X. B. Yang, Phonon-mediated superconductivity in Mg intercalated bilayer borophenes, Phys. Chem. Chem. Phys. 19(43), 29237 (2017)
https://doi.org/10.1039/C7CP06180C
102 M. Gao, Q. Z. Li, X.W. Yan, and J. Wang, Prediction of phonon-mediated superconductivity in borophene, Phys. Rev. B 95, 024505 (2017)
https://doi.org/10.1103/PhysRevB.95.024505
103 H. L. Li, L. Jing, W. W. Liu, J. J. Lin, R. Y. Tay, S. H. Tsang, and E. H. T. Teo, Scalable production of fewlayer boron sheets by liquid-phase exfoliation and their superior supercapacitive performance, ACS Nano 12(2), 1262 (2018)
https://doi.org/10.1021/acsnano.7b07444
104 G. Li, Y. Zhao, S. Zeng, M. Zulfiqar, and J. Ni, Strain effect on the superconductivity in borophenes, J. Phys. Chem. C 122(29), 16916 (2018)
https://doi.org/10.1021/acs.jpcc.8b03108
105 C. Cheng, J. T. Sun, H. Liu, H. X. Fu, J. Zhang, X. R. Chen, and S. Meng, Suppressed superconductivity in substrate-supported β12 borophene by tensile strain and electron doping, 2D Materials 4, 025032 (2017)
106 J. C. Zheng and Y. M. Zhu, Searching for a higher superconducting transition temperature in strained MgB2, Phys. Rev. B 73(2), 024509 (2006)
https://doi.org/10.1103/PhysRevB.73.024509
107 H. R. Jiang, Z. Lu, M. C. Wu, F. Ciucci, and T. S. Zhao, Borophene: A promising anode material offering high specific capacity and high rate capability for lithium-ion batteries, Nano Energy 23, 97 (2016)
https://doi.org/10.1016/j.nanoen.2016.03.013
108 G. A. Tritsaris, E. Kaxiras, S. Meng, and E. Wang, Adsorption and diffusion of lithium on layered silicon for Li-ion storage, Nano Lett. 13(5), 2258 (2013)
https://doi.org/10.1021/nl400830u
109 Q. F. Li, C. G. Duan, X. G. Wan, and J. L. Kuo, Theoretical prediction of anode materials in Li-ion batteries on layered black and blue phosphorus, J. Phys. Chem. C 119(16), 8662 (2015)
https://doi.org/10.1021/jp512411g
110 Y. Jing, Z. Zhou, C. R. Cabrera, and Z. Chen, Metallic VS2 monolayer: A promising 2D anode material for lithium ion batteries, J. Phys. Chem. C 117(48), 25409 (2013)
https://doi.org/10.1021/jp410969u
111 Q. Tang, Z. Zhou, and P. Shen, Are MXenes promising anode materials for Li ion batteries? Computational studies on electronic properties and Li storage capability of Ti3C2 and Ti3C2X2 (X= F, OH) monolayer, J. Am. Chem. Soc. 134(40), 16909 (2012)
https://doi.org/10.1021/ja308463r
112 B. Ziebarth, M. Klinsmann, T. Eckl, and C. Elsässer, Lithium diffusion in the spinel phase Li4Ti5O12 and in the rock salt phase Li7Ti5O12 of lithium titanate from first principles, Phys. Rev. B 89, 174301 (2014)
https://doi.org/10.1103/PhysRevB.89.174301
113 Z. Q. Wang, Y. C. Chen, and C. Y. Ouyang, Polaron states and migration in F-doped Li2MnO3, Phys. Lett. A 378(32-33), 2449 (2014)
https://doi.org/10.1016/j.physleta.2014.06.025
114 Z. Q. Wang, M. S. Wu, B. Xu, and C. Y. Ouyang, Improving the electrical conductivity and structural stability of the Li2MnO3 cathode via P doping, J. Alloys Compd. 658, 818 (2016)
https://doi.org/10.1016/j.jallcom.2015.11.013
115 J. Liu, C. Zhang, L. Xu, and S. Ju, Borophene as a promising anode material for sodium-ion batteries with high capacity and high rate capability using DFT, RSC Advances 8(32), 17773 (2018)
https://doi.org/10.1039/C8RA01942H
116 X. Zhang, J. Hu, Y. Cheng, H. Y. Yang, Y. Yao, and S. A. Yang, Borophene as an extremely high capacity electrode material for Li-ion and Na-ion batteries, Nanoscale 8(33), 15340 (2016)
https://doi.org/10.1039/C6NR04186H
117 L. Shi, T. Zhao, A. Xu, and J. Xu, Ab initio prediction of borophene as an extraordinary anode material exhibiting ultrafast directional sodium diffusion for sodium-based batteries, Sci. Bull. (Beijing) 61(14), 1138 (2016)
https://doi.org/10.1007/s11434-016-1118-7
118 S. Banerjee, G. Periyasamy, and S. K. Pati, Possible application of 2D-boron sheets as anode material in lithium ion battery: A DFT and AIMD study, J. Mater. Chem. A 2(11), 3856 (2014)
https://doi.org/10.1039/c3ta14041e
119 D. Rao, L. Zhang, Z. Meng, X. Zhang, Y. Wang, G. Qiao, X. Shen, H. Xia, J. Liu, and R. Lu, Ultrahigh energy storage and ultrafast ion diffusion in borophene-based anodes for rechargeable metal ion batteries, J. Mater. Chem. A Mater. Energy Sustain. 5(5), 2328 (2017)
https://doi.org/10.1039/C6TA09730H
120 N. Jiang, B. Li, F. Ning, and D. Xia, All boron-based 2D material as anode material in Li-ion batteries, J. Energy Chem. 27(6), 1651 (2018)
https://doi.org/10.1016/j.jechem.2018.01.026
121 P. Liang, Y. Cao, B. Tai, L. Zhang, H. Shu, F. Li, D. Chao, and X. Du, Is borophene a suitable anode material for sodium ion battery? J. Alloys Compd. 704, 152 (2017)
https://doi.org/10.1016/j.jallcom.2017.02.050
122 B. Mortazavi, O. Rahaman, S. Ahzi, and T. Rabczuk, Flat borophene films as anode materials for Mg, Na or Liion batteries with ultra high capacities: A first-principles study, Appl. Mater. Today 8, 60 (2017)
https://doi.org/10.1016/j.apmt.2017.04.010
123 Y. Zhang, Z. F. Wu, P. F. Gao, S. L. Zhang, and Y. H. Wen, Could borophene be used as a promising anode material for high-performance lithium ion battery? ACS Appl. Mater. Interfaces 8(34), 22175 (2016)
https://doi.org/10.1021/acsami.6b05747
124 J. Liu, L. Zhang, and L. Xu, Theoretical prediction of borophene monolayer as anode materials for highperformance lithium-ion batteries, Ionics(2017)
125 H. Chen, W. Zhang, X. Q. Tang, Y. H. Ding, J. R. Yin, Y. Jiang, P. Zhang, and H. B. Jin, First principles study of P-doped borophene as anode materials for lithium ion batteries, Appl. Surf. Sci. 427, 198 (2018)
https://doi.org/10.1016/j.apsusc.2017.08.178
126 N. K. Jena, R. B. Araujo, V. Shukla, and R. Ahuja, Borophane as a Benchmate of Graphene: A Potential 2D Material for Anode of Li and Na-Ion Batteries, ACS Appl. Mater. Interfaces 9(19), 16148 (2017)
https://doi.org/10.1021/acsami.7b01421
127 F. Li, Y. Su, and J. Zhao, Shuttle inhibition by chemical adsorption of lithium polysulfides in B and N co-doped graphene for Li-S batteries, Phys. Chem. Chem. Phys. 18(36), 25241 (2016)
https://doi.org/10.1039/C6CP04071C
128 L. Zhang, P. Liang, H. B. Shu, X. L. Man, F. Li, J. Huang, Q. M. Dong, and D. L. Chao, Borophene as efficient sulfur hosts for lithium–sulfur batteries: suppressing shuttle effect and improving conductivity, J. Phys. Chem. C 121(29), 15549 (2017)
https://doi.org/10.1021/acs.jpcc.7b03741
129 H. R. Jiang, W. Shyy, M. Liu, Y. X. Ren, and T. S. Zhao, Borophene and defective borophene as potential anchoring materials for lithium–sulfur batteries: a firstprinciples study, J. Mater. Chem. A 6(5), 2107 (2018)
https://doi.org/10.1039/C7TA09244J
130 F. Li and J. J. Zhao, Atomic sulfur anchored on silicene, phosphorene, and borophene for excellent cycle performance of Li-S batteries, ACS Appl. Mater. Interfaces 9(49), 42836 (2017)
https://doi.org/10.1021/acsami.7b14685
131 H. R. Jiang, W. Shyy, M. Liu, Y. X. Ren, and T. S. Zhao, Borophene and defective borophene as potential anchoring materials for lithium–sulfur batteries: A firstprinciples study, J. Mater. Chem. A 6(5), 2107 (2018)
https://doi.org/10.1039/C7TA09244J
132 S. P. Jand, Y. X. Chen, and P. Kaghazchi, Comparative theoretical study of adsorption of lithium polysulfides (Li2Sx) on pristine and defective graphene, J. Power Sources 308, 166 (2016)
https://doi.org/10.1016/j.jpowsour.2016.01.062
133 J. Zhao, Y. Yang, R. S. Katiyar, and Z. Chen, Phosphorene as a promising anchoring material for lithium–sulfur batteries: a computational study, J. Mater. Chem. A 4(16), 6124 (2016)
https://doi.org/10.1039/C6TA00871B
134 S. Er, G. A. de Wijs, and G. Brocks, DFT study of planar boron sheets: A new template for hydrogen storage, J. Phys. Chem. C 113(43), 18962 (2009)
https://doi.org/10.1021/jp9077079
135 L. Yuan, L. Kang, Y. Chen, D. Wang, J. Gong, C. Wang, M. Zhang, and X. Wu, Hydrogen storage capacity on Ti-decorated porous graphene: First-principles investigation, Appl. Surf. Sci. 434, 843 (2018)
https://doi.org/10.1016/j.apsusc.2017.10.231
136 L. Li, H. Zhang, and X. Cheng, The high hydrogen storage capacities of Li-decorated borophene, Comput. Mater. Sci. 137, 119 (2017)
https://doi.org/10.1016/j.commatsci.2017.05.032
137 X. Chen, L. Wang, W. Zhang, J. Zhang, and Y. Yuan, Cadecorated borophene as potential candidates for hydrogen storage: A first-principle study, Int. J. Hydrogen Energy 42(31), 20036 (2017)
https://doi.org/10.1016/j.ijhydene.2017.06.143
138 J. Wang, Y. Du, and L. Sun, Ca-decorated novel boron sheet: A potential hydrogen storage medium, Int. J. Hydrogen Energy 41(10), 5276 (2016)
https://doi.org/10.1016/j.ijhydene.2016.01.039
139 S. Haldar, S. Mukherjee, and C. V. Singh, Hydrogen storage in Li, Na and Ca decorated and defective borophene: A first principles study, RSC Advances 8(37), 20748 (2018)
https://doi.org/10.1039/C7RA12512G
140 F. Zhang, R. Chen, W. Zhang, and W. Zhang, A Tidecorated boron monolayer: A promising material for hydrogen storage, RSC Advances 6(16), 12925 (2016)
https://doi.org/10.1039/C5RA23459J
141 X. Tang, Y. Gu, and L. Kou, Theoretical investigation of calcium-decorated b 12 boron sheet for hydrogen storage, Chem. Phys. Lett. 695, 211 (2018)
https://doi.org/10.1016/j.cplett.2018.02.022
142 T. A. Abtew, B. C. Shih, P. Dev, V. H. Crespi, and P. H. Zhang, Prediction of a multicenter-bonded solid boron hydride for hydrogen storage, Phys. Rev. B 83(9), 094108 (2011)
https://doi.org/10.1103/PhysRevB.83.094108
143 Y. S. Wang, F. Wang, M. Li, B. Xu, Q. Sun, and Y. Jia, Theoretical prediction of hydrogen storage on Li decorated planar boron sheets, Appl. Surf. Sci. 258(22), 8874 (2012)
https://doi.org/10.1016/j.apsusc.2012.05.107
144 J. L. Li, H. Y. Zhang, and G. W. Yang, Ultrahighcapacity molecular hydrogen storage of a lithiumdecorated boron monolayer, J. Phys. Chem. C 119(34), 19681 (2015)
https://doi.org/10.1021/acs.jpcc.5b06164
145 I. Cabria, M. J. López, and J. A. Alonso, Density functional calculations of hydrogen adsorption on boron nanotubes and boron sheets, Nanotechnology 17(3), 778 (2006)
https://doi.org/10.1088/0957-4484/17/3/027
146 A. Lebon, R. H. Aguilera-del-Toro, L. J. Gallego, and A. Vega, Li-decorated Pmmn8 phase of borophene for hydrogen storage: A van der Waals corrected densityfunctional theory study, Int. J. Hydrogen Energy 44(2), 1021 (2019)
https://doi.org/10.1016/j.ijhydene.2018.10.241
147 T. Liu, Y. Chen, H. Wang, M. Zhang, L. Yuan, and C. Zhang, Li-decoratedβ12-borophene as potential candidates for hydrogen storage: a first-principle study, Materials (Basel) 10(12), 1399 (2017)
https://doi.org/10.3390/ma10121399
148 Y. F. Zhang and X. L. Cheng, Hydrogen adsorption property of Na-decorated boron monolayer: A first principles investigation, Physica E 107, 170 (2019)
https://doi.org/10.1016/j.physe.2018.11.041
149 C. Ataca, E. Aktürk, S. Ciraci, and H. Ustunel, Highcapacity hydrogen storage by metallized graphene, Appl. Phys. Lett. 93(4), 043123 (2008)
https://doi.org/10.1063/1.2963976
150 B. Xu, X. L. Lei, G. Liu, M. S. Wu, and C. Y. Ouyang, Li-decorated graphyne as high-capacity hydrogen storage media: First-principles plane wave calculations, Int. J. Hydrogen Energy 39(30), 17104 (2014)
https://doi.org/10.1016/j.ijhydene.2014.07.182
151 F. Li, C. W. Zhang, H. X. Luan, and P. J. Wang, Firstprinciples study of hydrogen storage on Li-decorated silicene, J. Nanopart. Res. 15(10), 1972 (2013)
https://doi.org/10.1007/s11051-013-1972-z
152 X. L. Lei, G. Liu, M. S. Wu, B. Xu, C. Y. Ouyang, and B. C. Pan, Hydrogen storage on calcium-decorated BC7 sheet: A first-principles study, Int. J. Hydrogen Energy 39(5), 2142 (2014)
https://doi.org/10.1016/j.ijhydene.2013.11.099
153 C. Zhang, S. Tang, M. Deng, and Y. Du, Li adsorption on monolayer and bilayer MoS2 as an ideal substrate for hydrogen storage, Chin. Phys. B 27(6), 066103 (2018)
https://doi.org/10.1088/1674-1056/27/6/066103
154 M. Moradi, and N. Naderi, First principle study of hydrogen storage on the graphene-like aluminum nitride nanosheet, Struct. Chem. 25(4), 1289 (2014)
https://doi.org/10.1007/s11224-014-0410-x
155 L. Shi, C. Ling, Y. Ouyang, and J. Wang, High intrinsic catalytic activity of two-dimensional boron monolayers for the hydrogen evolution reaction, Nanoscale 9(2), 533 (2017)
https://doi.org/10.1039/C6NR06621F
156 S. H. Mir, S. Chakraborty, P. C. Jha, J. Wärnå, H. Soni, P. K. Jha, and R. Ahuja, Two-dimensional boron: Lightest catalyst for hydrogen and oxygen evolution reaction, Appl. Phys. Lett. 109(5), 053903 (2016)
https://doi.org/10.1063/1.4960102
157 J. K. Nørskov, T. Bligaard, A. Logadottir, J. R. Kitchin, J. G. Chen, S. Pandelov, and U. Stimming, Trends in the exchange current for hydrogen evolution, J. Electrochem. Soc. 152(3), J23 (2005)
https://doi.org/10.1149/1.1856988
158 C. W. Liu, Z. X. Dai, J. Zhang, Y. G. Jin, D. S. Li, and C. H. Sun, Two-dimensional boron sheets as metalfree catalysts for hydrogen evolution reaction, J. Phys. Chem. C 122(33), 19051 (2018)
https://doi.org/10.1021/acs.jpcc.8b05859
159 H. Park, A. Encinas, J. P. Scheifers, Y. Zhang, and B. P. T. Fokwa, Boron-dependency of molybdenum boride electrocatalysts for the hydrogen evolution reaction, Angew. Chem. Int. Ed. 56(20), 5575 (2017)
https://doi.org/10.1002/anie.201611756
160 Y. Chen, G. Yu, W. Chen, Y. Liu, G. D. Li, P. Zhu, Q. Tao, Q. Li, J. Liu, X. Shen, H. Li, X. Huang, D. Wang, T. Asefa, and X. Zou, Highly active, nonprecious electrocatalyst comprising borophene subunits for the hydrogen evolution reaction, J. Am. Chem. Soc. 139(36), 12370 (2017)
https://doi.org/10.1021/jacs.7b06337
161 P. Xiao, M. A. Sk, L. Thia, X. Ge, R. J. Lim, J.Y. Wang, K. H. Lim, and X. Wang, Molybdenum phosphide as an efficient electrocatalyst for the hydrogen evolution reaction, Energy Environ. Sci. 7(8), 2624 (2014)
https://doi.org/10.1039/C4EE00957F
162 Y. Singh, S. Back, and Y. Jung, Computational exploration of borophane-supported single transition metal atoms as potential oxygen reduction and evolution electrocatalysts, Phys. Chem. Chem. Phys. 20(32), 21095 (2018)
https://doi.org/10.1039/C8CP03130D
163 J. Rossmeisl, A. Logadottir, and J. K. Nørskov, Electrolysis of water on (oxidized) metal surfaces, Chem. Phys. 319(1-3), 178 (2005)
https://doi.org/10.1016/j.chemphys.2005.05.038
164 X. Tan, H. A. Tahini, and S. C. Smith, Borophene as a promising material for charge-modulated switchable CO2 capture, ACS Appl. Mater. Interfaces 9(23), 19825 (2017)
https://doi.org/10.1021/acsami.7b03676
165 T. B. Tai and M. T. Nguyen, Interaction mechanism of CO2 ambient adsorption on transition-metal-coated boron sheets, Chemistry 19(9), 2942 (2013)
https://doi.org/10.1002/chem.201203664
166 H. Shen, Y. Li, and Q. Sun, Cu atomic chains supported on b-borophene sheets for effective CO2 electroreduction, Nanoscale 10(23), 11064 (2018)
https://doi.org/10.1039/C8NR01855C
167 V. Nagarajan and R. Chandiramouli, Borophene nanosheet molecular device for detection of ethanol – A first-principles study, Comput. Theor. Chem. 1105, 52 (2017)
https://doi.org/10.1016/j.comptc.2017.02.023
168 A. Shahbazi Kootenaei and G. Ansari, B36 borophene as an electronic sensor for formaldehyde: Quantum chemical analysis, Phys. Lett. A 380(34), 2664 (2016)
https://doi.org/10.1016/j.physleta.2016.06.016
169 A. Omidvar, Borophene: A novel boron sheet with a hexagonal vacancy offering high sensitivity for hydrogen cyanide detection, Comput. Theor. Chem. 1115, 179 (2017)
https://doi.org/10.1016/j.comptc.2017.06.018
170 R. Chandiramouli and V. Nagarajan, Borospherene nanostructure as CO and NO sensor – A first-principles study, Vacuum 142, 13 (2017)
https://doi.org/10.1016/j.vacuum.2017.04.040
171 V. Shukla, J. Wärnå, N. K. Jena, A. Grigoriev, and R. Ahuja, Toward the realization of 2D borophene based gas sensor, J. Phys. Chem. C 121(48), 26869 (2017)
https://doi.org/10.1021/acs.jpcc.7b09552
172 R. Y. Guo, T. Li, S. E. Shi, and T. H. Li, Oxygen defects formation and optical identification in monolayer borophene, Mater. Chem. Phys. 198, 346 (2017)
https://doi.org/10.1016/j.matchemphys.2017.06.007
173 Q. Li, Q. Zhou, X. Niu, Y. Zhao, Q. Chen, and J. Wang, Covalent functionalization of black phosphorus from firstprinciples, J. Phys. Chem. Lett. 7(22), 4540 (2016)
https://doi.org/10.1021/acs.jpclett.6b02192
174 Z. Zhang, E. S. Penev, and B. I. Yakobson, Twodimensional boron: Structures, properties and applications, Chem. Soc. Rev. 46(22), 6746 (2017)
https://doi.org/10.1039/C7CS00261K
Viewed
Full text


Abstract

Cited

  Shared   
  Discussed